Chem
J-GLOBAL ID:200907048599580762
Nikkaji number:J1.495.780D
(4aR)-1-Oxo-2-methyl-6,7-dimethyl-1,2,4aα,5,8,8aα-hexahydroisoquinoline-3-carboxylic acid methyl ester
(4aR)-1-オキソ-2-メチル-6,7-ジメチル-1,2,4aα,5,8,8aα-ヘキサヒドロイソキノリン-3-カルボン酸メチル
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C14 H19 NO3
Molecular formula furigana:
C14-H19-N-O3
Molecular weight:
249.310
InChI:
InChI=1S/C14H19NO3/c1-8-5-10-7-12(14(17)18-4)15(3)13(16)11(10)6-9(8)2/h7,10-11H,5-6H2,1-4H3/t10-,11-/m1/s1
InChI key:
ODGMXINIHSVHJU-GHMZBOCLSA-N
SMILES:
COC(=O)C1=C[C@H]2CC(=C(C)C[C@H]2C(=O)N1C)C
Systematic name (3):
(4aR)-1-オキソ-2-メチル-6,7-ジメチル-1,2,4aα,5,8,8aα-ヘキサヒドロイソキノリン-3-カルボン酸メチル
メチル (4aR,8aR)-2,6,7-トリメチル-1-オキソ-1,2,4a,5,8,8a-ヘキサヒドロイソキノリン-3-カルボキシラート
methyl (4aR,8aR)-2,6,7-trimethyl-1-oxo-1,2,4a,5,8,8a-hexahydroisoquinoline-3-carboxylate
Other name (1):
(4aR)-1-Oxo-2-methyl-6,7-dimethyl-1,2,4aα,5,8,8aα-hexahydroisoquinoline-3-carboxylic acid methyl ester
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